# generated using pymatgen
data_KBa3(FeAs)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.16214702
_cell_length_b   8.71998490
_cell_length_c   7.85870106
_cell_angle_alpha   64.32572445
_cell_angle_beta   73.72605176
_cell_angle_gamma   97.22124646
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KBa3(FeAs)8
_chemical_formula_sum   'K1 Ba3 Fe8 As8'
_cell_volume   406.93629940
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  K  K0  1  -0.00000000  -0.00000000  -0.00000000  1.0
  Ba  Ba1  1  -0.00004475  0.49356017  0.75338538  1.0
  Ba  Ba2  1  -0.00000000  -0.00000000  0.50000000  1.0
  Ba  Ba3  1  0.00004475  0.50643983  0.24661462  1.0
  Fe  Fe4  1  0.50030941  0.62524369  0.31307392  1.0
  Fe  Fe5  1  0.50054052  0.62532921  0.81352182  1.0
  Fe  Fe6  1  0.49976096  0.12478944  0.06233642  1.0
  Fe  Fe7  1  0.49970149  0.12481702  0.56245551  1.0
  Fe  Fe8  1  0.49969059  0.37475631  0.68692608  1.0
  Fe  Fe9  1  0.49945948  0.37467079  0.18647818  1.0
  Fe  Fe10  1  0.50029851  0.87518298  0.43754449  1.0
  Fe  Fe11  1  0.50023904  0.87521056  0.93766358  1.0
  As  As12  1  0.30279952  0.32707599  0.50959616  1.0
  As  As13  1  0.30211787  0.32758739  0.01125067  1.0
  As  As14  1  0.30052453  0.82364340  0.26395544  1.0
  As  As15  1  0.30095636  0.82385274  0.76273919  1.0
  As  As16  1  0.69720048  0.67292401  0.49040384  1.0
  As  As17  1  0.69788213  0.67241261  0.98874933  1.0
  As  As18  1  0.69904364  0.17614726  0.23726081  1.0
  As  As19  1  0.69947547  0.17635660  0.73604456  1.0